# generated using pymatgen
data_LiFe(PO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.46221900
_cell_length_b   7.26403600
_cell_length_c   7.68813402
_cell_angle_alpha   87.93639028
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiFe(PO3)4
_chemical_formula_sum   'Li2 Fe2 P8 O24'
_cell_volume   472.28205847
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.69691700  0.73518800  0.35187400  1
  Li  Li1  1  0.19691700  0.26481200  0.64812600  1
  Fe  Fe2  1  0.49398400  0.74482600  0.82990700  1
  Fe  Fe3  1  0.99398400  0.25517400  0.17009300  1
  P  P4  1  0.29022100  0.91816900  0.47634900  1
  P  P5  1  0.87901400  0.93221300  0.87292800  1
  P  P6  1  0.07061700  0.64855400  0.30550900  1
  P  P7  1  0.12480100  0.62612800  0.93841100  1
  P  P8  1  0.62480100  0.37387200  0.06158900  1
  P  P9  1  0.57061700  0.35144600  0.69449100  1
  P  P10  1  0.37901400  0.06778700  0.12707200  1
  P  P11  1  0.79022100  0.08183100  0.52365100  1
  O  O12  1  0.39853600  0.93782600  0.30079300  1
  O  O13  1  0.42474200  0.94930900  0.97910900  1
  O  O14  1  0.91111600  0.73078600  0.30453500  1
  O  O15  1  0.68626400  0.92005100  0.51136800  1
  O  O16  1  0.72235100  0.83687700  0.88045300  1
  O  O17  1  0.18982100  0.73188000  0.44334700  1
  O  O18  1  0.39890300  0.86985100  0.62433200  1
  O  O19  1  0.01816400  0.78374700  0.84233900  1
  O  O20  1  0.16196700  0.70710700  0.12542000  1
  O  O21  1  0.27684400  0.61741800  0.83914400  1
  O  O22  1  0.08406200  0.44058800  0.33280200  1
  O  O23  1  0.53534400  0.55346200  0.04346500  1
  O  O24  1  0.03534400  0.44653800  0.95653500  1
  O  O25  1  0.58406200  0.55941200  0.66719800  1
  O  O26  1  0.77684400  0.38258200  0.16085600  1
  O  O27  1  0.66196700  0.29289300  0.87458000  1
  O  O28  1  0.51816400  0.21625300  0.15766100  1
  O  O29  1  0.89890300  0.13014900  0.37566800  1
  O  O30  1  0.68982100  0.26812000  0.55665300  1
  O  O31  1  0.22235100  0.16312300  0.11954700  1
  O  O32  1  0.18626400  0.07994900  0.48863200  1
  O  O33  1  0.41111600  0.26921400  0.69546500  1
  O  O34  1  0.92474200  0.05069100  0.02089100  1
  O  O35  1  0.89853600  0.06217400  0.69920700  1
